==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-DEC-10 3PVQ . COMPND 2 MOLECULE: DIPEPTIDYL-PEPTIDASE VI; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 594 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24791.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 393 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 198 33.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 33 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 67 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 4 0 0 2 0 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 8 4 10 6 12 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 0 0 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 32 A A 0 0 88 0, 0.0 33,-2.7 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -17.8 34.6 35.6 61.1 2 33 A Y E +AB 33 61A 57 59,-0.8 59,-2.9 31,-0.3 2,-0.3 -0.955 360.0 168.5-130.7 149.3 35.2 32.5 63.2 3 34 A G E -AB 32 60A 0 29,-2.3 29,-2.7 -2,-0.3 2,-0.3 -0.950 22.4-142.3-151.0 166.0 38.3 30.8 64.6 4 35 A V E -AB 31 59A 0 55,-1.3 55,-3.0 -2,-0.3 2,-0.3 -0.998 29.4-115.4-133.6 135.3 39.4 28.0 67.0 5 36 A V E - B 0 58A 0 25,-2.1 24,-3.2 -2,-0.3 53,-0.2 -0.544 28.6-176.5 -70.9 130.7 42.5 28.2 69.3 6 37 A H + 0 0 23 51,-2.2 2,-0.3 -2,-0.3 52,-0.1 0.175 57.3 71.2-120.0 19.8 45.1 25.6 68.2 7 38 A I S S- 0 0 2 50,-0.4 3,-0.2 1,-0.1 449,-0.1 -0.922 91.5-107.3-126.0 154.7 47.9 26.0 70.9 8 39 A S S S+ 0 0 0 447,-0.4 20,-1.7 -2,-0.3 2,-0.3 0.873 104.8 3.1 -48.0 -48.6 47.5 25.0 74.6 9 40 A V E S-C 27 0A 2 18,-0.2 2,-0.3 89,-0.1 -1,-0.2 -0.975 71.8-161.1-142.1 122.6 47.3 28.7 75.8 10 41 A C E -C 26 0A 0 16,-2.8 16,-1.1 -2,-0.3 2,-0.7 -0.742 18.8-127.3-107.3 155.7 47.3 31.7 73.5 11 42 A N E -C 25 0A 22 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.899 17.5-159.2-110.3 102.6 48.1 35.2 74.7 12 43 A X E -C 24 0A 0 12,-2.1 11,-2.9 -2,-0.7 12,-1.5 -0.699 16.4-163.1 -83.1 131.9 45.5 37.9 73.9 13 44 A R E -CD 22 52A 13 39,-2.2 39,-2.7 -2,-0.4 9,-0.3 -0.771 32.8-114.5-119.4 161.5 46.9 41.5 74.0 14 45 A D S S+ 0 0 105 7,-2.7 2,-0.3 -2,-0.3 8,-0.1 0.826 103.6 18.3 -59.8 -36.9 45.6 45.1 74.2 15 46 A E S S- 0 0 109 2,-0.3 2,-2.0 6,-0.2 5,-0.2 -0.871 95.5 -92.3-131.2 165.2 46.9 45.8 70.6 16 47 A G S S+ 0 0 28 -2,-0.3 2,-0.3 24,-0.1 37,-0.1 -0.365 97.2 77.3 -78.5 59.5 48.1 43.6 67.6 17 48 A K S > S- 0 0 87 -2,-2.0 3,-1.2 35,-0.1 -2,-0.3 -0.952 81.1-123.1-163.1 147.2 51.8 43.6 68.7 18 49 A F T 3 S+ 0 0 48 -2,-0.3 4,-0.1 1,-0.3 -1,-0.0 0.770 108.1 68.3 -65.7 -27.3 53.9 41.7 71.3 19 50 A T T 3 S+ 0 0 100 300,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.176 86.8 86.4 -81.1 17.5 55.1 45.0 72.8 20 51 A S S < S- 0 0 9 -3,-1.2 2,-0.1 -5,-0.2 298,-0.1 -0.829 92.3 -91.7-113.6 152.2 51.5 45.6 74.0 21 52 A G - 0 0 28 -2,-0.3 -7,-2.7 296,-0.1 -6,-0.2 -0.387 37.0-111.6 -67.9 143.0 50.3 44.3 77.4 22 53 A X E -C 13 0A 8 -9,-0.3 -9,-0.3 1,-0.1 3,-0.1 -0.506 31.2-178.7 -70.6 137.2 48.6 41.0 77.7 23 54 A S E - 0 0 14 -11,-2.9 2,-0.3 1,-0.4 -10,-0.2 0.693 60.3 -30.0-110.2 -30.8 44.8 41.3 78.6 24 55 A T E -C 12 0A 1 -12,-1.5 -12,-2.1 138,-0.1 -1,-0.4 -0.938 57.3-118.2-170.7-178.3 43.7 37.6 78.8 25 56 A Q E -C 11 0A 12 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.990 12.9-154.5-141.4 145.6 44.4 34.1 77.5 26 57 A A E -C 10 0A 0 -16,-1.1 -16,-2.8 -2,-0.3 2,-0.3 -0.794 20.1-124.2-117.5 163.9 42.3 31.5 75.5 27 58 A L E > -C 9 0A 9 -2,-0.3 3,-2.2 -18,-0.2 -22,-0.3 -0.753 32.0 -78.6-115.1 158.9 42.8 27.7 75.4 28 59 A L T 3 S+ 0 0 1 -20,-1.7 75,-2.0 -2,-0.3 -22,-0.2 -0.175 116.9 13.2 -50.1 128.0 43.3 24.9 72.9 29 60 A G T 3 S+ 0 0 4 -24,-3.2 -1,-0.3 1,-0.3 -23,-0.1 0.354 90.2 140.6 84.3 -1.2 40.1 24.0 71.2 30 61 A X < - 0 0 18 -3,-2.2 -25,-2.1 -25,-0.1 -1,-0.3 -0.577 51.1-128.7 -77.3 126.7 38.2 27.1 72.4 31 62 A P E -A 4 0A 0 0, 0.0 2,-0.3 0, 0.0 -27,-0.2 -0.512 32.3-179.1 -75.0 141.9 35.9 28.6 69.8 32 63 A V E -A 3 0A 0 -29,-2.7 -29,-2.3 -2,-0.2 2,-0.3 -0.977 28.1-121.0-135.6 156.0 36.3 32.4 69.2 33 64 A K E -AE 2 44A 47 11,-2.3 11,-2.1 -2,-0.3 2,-0.6 -0.753 24.9-137.8 -91.1 144.8 34.8 35.1 67.1 34 65 A V E + E 0 43A 21 -33,-2.7 9,-0.2 -2,-0.3 3,-0.1 -0.937 23.0 177.5-104.8 117.7 37.2 36.9 64.7 35 66 A L E - 0 0 76 7,-3.3 2,-0.3 -2,-0.6 8,-0.2 0.747 62.3 -16.6 -92.4 -31.5 36.5 40.7 64.7 36 67 A Q E - E 0 42A 90 6,-1.1 6,-2.5 -35,-0.0 2,-0.4 -0.973 50.0-136.7-167.7 164.0 39.3 41.8 62.3 37 68 A Y E + E 0 41A 140 -2,-0.3 4,-0.2 4,-0.2 -3,-0.0 -0.995 30.6 151.3-132.1 124.2 42.6 40.9 60.7 38 69 A T S S- 0 0 96 2,-2.5 3,-0.1 -2,-0.4 -1,-0.1 0.237 93.5 -64.3-129.6 3.0 45.6 43.4 60.4 39 70 A G S S+ 0 0 29 1,-0.7 16,-0.8 16,-0.0 2,-0.3 -0.246 137.1 60.3 127.3 -30.3 48.4 40.7 60.3 40 71 A W E S- F 0 54A 31 14,-0.2 -2,-2.5 15,-0.1 -1,-0.7 -0.803 91.6-120.6-113.3 151.8 47.2 39.9 63.9 41 72 A Y E -EF 37 53A 35 12,-2.9 12,-2.4 -2,-0.3 2,-0.7 -0.879 8.1-146.1 -99.7 133.9 43.6 38.8 64.6 42 73 A E E -EF 36 52A 34 -6,-2.5 -7,-3.3 -2,-0.5 -6,-1.1 -0.886 34.7-178.9 -93.0 115.7 41.3 40.6 67.0 43 74 A I E -EF 34 51A 0 8,-2.9 8,-2.1 -2,-0.7 2,-0.4 -0.806 25.2-144.0-117.0 164.7 39.3 37.8 68.6 44 75 A Q E -EF 33 50A 40 -11,-2.1 -11,-2.3 -2,-0.3 6,-0.2 -0.991 16.5-146.9-131.3 121.2 36.5 37.5 71.1 45 76 A T > - 0 0 3 4,-2.3 3,-2.2 -2,-0.4 -13,-0.1 -0.310 37.2 -93.3 -83.3 167.1 36.4 34.7 73.7 46 77 A P T 3 S+ 0 0 7 0, 0.0 247,-0.2 0, 0.0 246,-0.1 0.585 124.9 64.0 -61.6 -5.3 33.1 33.0 75.0 47 78 A D T 3 S- 0 0 23 2,-0.1 142,-0.3 244,-0.1 3,-0.1 0.217 119.1-111.7 -95.0 8.3 33.2 35.5 78.0 48 79 A D S < S+ 0 0 103 -3,-2.2 2,-0.1 1,-0.3 0, 0.0 0.370 72.1 143.5 70.5 4.1 32.7 38.4 75.5 49 80 A Y - 0 0 59 -5,-0.1 -4,-2.3 -4,-0.0 2,-0.4 -0.446 38.6-148.6 -73.8 138.4 36.3 39.6 76.2 50 81 A T E + F 0 44A 61 -6,-0.2 2,-0.3 -2,-0.1 -6,-0.2 -0.897 28.2 144.8-111.9 144.8 38.2 41.0 73.2 51 82 A G E - F 0 43A 2 -8,-2.1 -8,-2.9 -2,-0.4 2,-0.4 -0.965 41.3 -99.6-165.8 169.0 42.0 40.9 72.6 52 83 A W E +DF 13 42A 34 -39,-2.7 -39,-2.2 -2,-0.3 2,-0.3 -0.841 31.4 178.5-108.8 138.4 44.7 40.5 69.9 53 84 A V E - F 0 41A 1 -12,-2.4 -12,-2.9 -2,-0.4 -41,-0.1 -0.943 36.2 -95.6-132.6 154.4 46.7 37.3 68.8 54 85 A H E > - F 0 40A 35 -2,-0.3 3,-1.5 -14,-0.2 4,-0.3 -0.299 41.3-110.9 -61.9 149.2 49.3 36.5 66.2 55 86 A R G > S+ 0 0 26 -16,-0.8 3,-0.7 1,-0.3 -1,-0.1 0.777 110.4 59.1 -54.9 -34.7 48.0 35.0 62.9 56 87 A X G 3 S+ 0 0 90 1,-0.2 -1,-0.3 3,-0.1 488,-0.1 0.426 90.8 67.0 -83.4 0.9 49.5 31.5 63.6 57 88 A V G < S+ 0 0 10 -3,-1.5 -51,-2.2 -52,-0.0 -50,-0.4 0.606 96.5 53.4-101.1 -8.5 47.8 30.7 66.9 58 89 A I E < S-B 5 0A 4 -3,-0.7 -53,-0.2 -4,-0.3 -55,-0.0 -0.884 72.0-134.5-123.2 154.9 44.2 30.3 65.7 59 90 A T E -B 4 0A 24 -55,-3.0 -55,-1.3 -2,-0.3 2,-0.1 -0.922 24.6-143.8-103.0 105.3 42.6 28.3 62.9 60 91 A P E -B 3 0A 71 0, 0.0 2,-0.3 0, 0.0 -57,-0.3 -0.430 27.5-179.4 -66.2 146.2 40.1 30.6 61.0 61 92 A X E -B 2 0A 34 -59,-2.9 -59,-0.8 -2,-0.1 2,-0.1 -0.983 32.0-105.9-144.9 157.5 37.0 28.7 59.9 62 93 A S > - 0 0 57 -2,-0.3 4,-2.4 -61,-0.1 5,-0.2 -0.336 46.0-104.9 -70.4 162.8 33.7 29.1 58.0 63 94 A K H > S+ 0 0 72 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.886 123.3 55.5 -58.0 -37.6 30.6 29.2 60.2 64 95 A E H > S+ 0 0 134 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.902 111.3 39.8 -60.2 -51.4 29.9 25.6 59.0 65 96 A K H > S+ 0 0 120 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.844 114.7 53.5 -73.6 -31.7 33.3 24.2 60.0 66 97 A Y H X S+ 0 0 7 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.906 111.2 46.9 -65.5 -41.7 33.3 26.2 63.3 67 98 A D H X S+ 0 0 15 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.873 111.9 50.7 -66.6 -38.1 29.8 24.7 64.0 68 99 A E H X S+ 0 0 85 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.894 109.2 50.9 -66.9 -41.2 31.2 21.2 63.1 69 100 A W H < S+ 0 0 17 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.937 112.3 46.9 -59.1 -47.7 34.2 21.7 65.5 70 101 A N H < S+ 0 0 22 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.854 111.7 51.3 -65.6 -32.7 31.8 22.7 68.3 71 102 A R H < S+ 0 0 176 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.812 88.6 96.7 -71.1 -38.7 29.4 19.7 67.6 72 103 A A S < S- 0 0 21 -4,-1.9 2,-0.1 -3,-0.1 -4,-0.0 -0.303 86.3-107.6 -58.7 135.0 32.2 17.0 67.7 73 104 A E - 0 0 71 33,-0.1 33,-2.7 32,-0.1 2,-0.2 -0.408 42.9-146.2 -64.8 133.4 32.7 15.2 71.0 74 105 A K E -G 105 0B 10 31,-0.2 60,-3.2 -2,-0.1 2,-0.5 -0.616 16.9-129.3 -99.5 161.8 35.8 16.3 72.7 75 106 A I E -GH 104 133B 1 29,-2.7 29,-2.1 58,-0.2 2,-0.4 -0.941 34.1-148.3 -97.6 124.4 38.5 14.8 74.8 76 107 A V E -GH 103 132B 2 56,-2.8 56,-2.2 -2,-0.5 2,-0.5 -0.895 8.4-130.9-101.8 131.6 38.7 17.3 77.8 77 108 A V E + H 0 131B 3 25,-2.7 24,-2.6 -2,-0.4 54,-0.3 -0.748 30.5 171.9 -83.5 120.4 42.1 17.8 79.5 78 109 A T + 0 0 46 52,-2.1 53,-0.2 -2,-0.5 2,-0.2 0.656 52.1 80.9-105.3 -25.8 41.5 17.4 83.3 79 110 A S S S- 0 0 39 51,-1.7 3,-0.1 1,-0.1 51,-0.1 -0.551 83.5-123.0 -79.8 152.1 45.1 17.4 84.6 80 111 A H S S+ 0 0 16 19,-0.2 20,-1.0 -2,-0.2 2,-0.3 0.917 90.3 15.3 -57.6 -48.2 46.9 20.8 85.1 81 112 A Y E S+I 99 0B 23 18,-0.2 2,-0.3 86,-0.1 18,-0.2 -0.956 73.5 116.6-132.5 153.2 49.8 19.8 82.8 82 113 A G E -I 98 0B 13 16,-1.5 16,-2.4 -2,-0.3 2,-0.3 -0.974 40.0-106.4 177.0-170.3 50.7 17.2 80.2 83 114 A F E -I 97 0B 27 14,-0.3 44,-0.5 -2,-0.3 2,-0.3 -0.898 13.2-135.5-136.9 161.6 51.6 16.3 76.6 84 115 A T E -I 96 0B 0 12,-2.1 11,-2.1 -2,-0.3 12,-0.5 -0.847 27.8-148.0-112.7 152.3 50.1 14.7 73.5 85 116 A Y E -IJ 94 125B 37 40,-2.6 40,-2.2 -2,-0.3 9,-0.2 -0.849 24.3-128.0-126.2 160.8 52.1 12.2 71.4 86 117 A E S S+ 0 0 114 7,-2.4 8,-0.1 -2,-0.3 -1,-0.1 0.740 100.5 29.9 -73.9 -26.3 52.5 11.1 67.8 87 118 A K S S- 0 0 136 2,-0.4 2,-2.9 6,-0.3 5,-0.2 -0.904 98.1 -96.9-127.7 158.5 52.0 7.4 68.9 88 119 A P S S+ 0 0 47 0, 0.0 2,-0.3 0, 0.0 24,-0.2 -0.382 98.9 94.3 -76.7 67.9 50.0 5.8 71.8 89 120 A D S > S- 0 0 74 -2,-2.9 3,-1.5 36,-0.1 -2,-0.4 -0.901 71.6-145.3-158.1 123.5 53.3 5.7 73.8 90 121 A D T 3 S+ 0 0 99 -2,-0.3 4,-0.1 1,-0.3 37,-0.0 0.478 101.7 61.7 -78.1 2.4 54.4 8.4 76.2 91 122 A D T 3 S+ 0 0 145 2,-0.1 -1,-0.3 -6,-0.0 2,-0.1 0.364 88.3 94.5-102.0 -0.1 58.0 7.7 75.1 92 123 A S S < S- 0 0 20 -3,-1.5 2,-0.0 -5,-0.2 -3,-0.0 -0.405 94.2 -68.0 -88.0 166.5 57.2 8.8 71.5 93 124 A Q - 0 0 56 -2,-0.1 -7,-2.4 -8,-0.1 -6,-0.3 -0.313 55.4-122.0 -55.3 130.9 57.7 12.3 70.0 94 125 A T E -I 85 0B 15 -9,-0.2 -9,-0.3 357,-0.2 3,-0.1 -0.323 16.8-162.7 -72.3 158.6 55.4 15.0 71.5 95 126 A V E - 0 0 13 -11,-2.1 2,-0.3 1,-0.5 -10,-0.1 0.747 69.3 -36.8-106.2 -47.0 52.9 17.0 69.4 96 127 A S E -I 84 0B 1 -12,-0.5 -12,-2.1 359,-0.1 -1,-0.5 -0.977 58.9 -95.5-163.4 171.0 52.3 19.8 72.0 97 128 A D E -I 83 0B 0 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.3 -0.511 38.7-156.9 -80.3 165.7 51.9 20.5 75.7 98 129 A V E -I 82 0B 0 -16,-2.4 -16,-1.5 -2,-0.2 2,-0.3 -0.939 6.4-160.9-138.2 158.5 48.3 20.6 77.1 99 130 A V E > -I 81 0B 0 -2,-0.3 3,-1.9 -18,-0.2 -22,-0.2 -0.912 42.8 -74.5-131.9 162.0 46.8 22.3 80.2 100 131 A A T 3 S+ 0 0 5 -20,-1.0 67,-0.3 -2,-0.3 -22,-0.2 -0.259 120.1 35.1 -53.7 139.9 43.4 21.7 82.0 101 132 A G T 3 S+ 0 0 6 -24,-2.6 -1,-0.2 1,-0.4 -74,-0.1 0.119 83.8 132.0 97.0 -19.7 40.5 23.0 80.0 102 133 A N < - 0 0 0 -3,-1.9 -25,-2.7 -25,-0.1 -1,-0.4 -0.383 40.3-161.2 -62.2 141.7 42.1 22.2 76.6 103 134 A R E -G 76 0B 9 -75,-2.0 2,-0.3 -27,-0.2 -27,-0.2 -1.000 10.5-178.3-135.8 128.9 39.7 20.3 74.3 104 135 A L E -G 75 0B 2 -29,-2.1 -29,-2.7 -2,-0.4 2,-0.3 -0.927 38.3 -94.4-124.6 152.4 40.5 18.2 71.3 105 136 A K E -GK 74 117B 59 12,-1.8 12,-1.7 -2,-0.3 2,-0.5 -0.519 40.9-124.6 -69.2 124.8 38.3 16.4 68.8 106 137 A W E + K 0 116B 79 -33,-2.7 10,-0.2 -2,-0.3 -33,-0.1 -0.630 37.5 167.8 -75.0 119.7 37.9 12.7 69.9 107 138 A E E - 0 0 72 8,-3.0 2,-0.3 -2,-0.5 9,-0.2 0.312 55.4 -65.8-114.1 -0.4 39.1 10.5 66.9 108 139 A G E - K 0 115B 27 7,-0.8 7,-2.2 2,-0.0 -1,-0.3 -0.921 50.3 -86.2 143.1-169.5 39.2 7.0 68.6 109 140 A S E + K 0 114B 77 5,-0.3 2,-0.3 -2,-0.3 5,-0.2 -0.999 26.7 175.4-144.2 142.2 41.1 5.0 71.3 110 141 A K E > - K 0 113B 125 3,-2.2 3,-1.5 -2,-0.3 2,-0.1 -0.912 64.1 -41.8-151.6 117.0 44.2 2.9 71.4 111 142 A G T 3 S- 0 0 67 -2,-0.3 -22,-0.1 1,-0.3 -1,-0.0 -0.420 123.9 -21.4 65.3-132.1 45.6 1.3 74.6 112 143 A H T 3 S+ 0 0 104 -24,-0.2 16,-2.5 -2,-0.1 17,-0.3 -0.001 125.4 90.6 -94.0 24.5 45.4 3.7 77.5 113 144 A F E < -KL 110 127B 22 -3,-1.5 -3,-2.2 14,-0.2 2,-0.4 -0.870 67.2-137.7-123.2 155.1 45.2 6.6 75.0 114 145 A Y E -KL 109 126B 29 12,-3.0 12,-2.7 -2,-0.3 2,-0.4 -0.936 23.7-129.9-105.9 133.7 42.6 8.6 73.1 115 146 A K E +KL 108 125B 56 -7,-2.2 -8,-3.0 -2,-0.4 -7,-0.8 -0.685 39.1 177.5 -79.4 131.1 43.3 9.5 69.5 116 147 A V E -KL 106 124B 0 8,-3.0 8,-2.7 -2,-0.4 2,-0.3 -0.936 22.0-149.4-133.6 162.3 42.7 13.2 69.1 117 148 A S E -KL 105 123B 9 -12,-1.7 -12,-1.8 -2,-0.3 6,-0.2 -0.972 15.2-131.8-136.4 148.4 42.9 15.9 66.4 118 149 A Y > - 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0 0 0 -3,-1.9 91,-2.3 1,-0.1 -1,-0.3 -0.367 62.1 -98.0 -61.8 140.7 51.3 28.3 90.9 159 190 A P B -M 248 0C 3 0, 0.0 11,-2.0 0, 0.0 89,-0.3 -0.262 26.9-116.7 -66.6 150.9 52.8 31.7 89.9 160 191 A Y B -n 170 0D 16 87,-2.3 2,-0.3 9,-0.2 11,-0.2 -0.614 35.8-178.2 -75.2 139.8 50.8 34.9 89.5 161 192 A L > - 0 0 14 9,-1.4 3,-2.5 -2,-0.3 13,-0.1 -0.944 32.9-113.9-144.1 120.2 50.9 36.1 86.0 162 193 A W T 3 S+ 0 0 81 -2,-0.3 3,-0.1 1,-0.3 -140,-0.1 -0.396 106.4 2.9 -54.3 123.5 49.2 39.4 84.8 163 194 A A T 3 S+ 0 0 0 1,-0.3 -1,-0.3 -140,-0.2 -151,-0.2 0.438 94.2 158.1 70.1 8.3 46.3 38.3 82.5 164 195 A G < + 0 0 0 -3,-2.5 7,-1.7 1,-0.1 -1,-0.3 -0.399 13.3 168.8 -62.1 125.1 47.2 34.7 83.2 165 196 A T E +O 170 0D 12 5,-0.2 2,-0.3 -2,-0.1 5,-0.2 -0.078 49.8 59.9-134.0 35.1 44.1 32.5 82.5 166 197 A S E > S-O 169 0D 2 3,-1.3 3,-1.4 -157,-0.1 12,-0.1 -0.939 95.8 -87.4-152.4 173.5 45.4 28.9 82.6 167 198 A S T 3 S+ 0 0 0 -67,-0.3 3,-0.1 -2,-0.3 -86,-0.1 0.729 117.1 70.6 -58.6 -22.5 47.1 26.3 84.9 168 199 A K T 3 S- 0 0 18 1,-0.3 -1,-0.2 -88,-0.1 2,-0.2 0.817 122.4 -29.0 -63.0 -36.1 50.5 27.8 83.7 169 200 A G E < - 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